4-[3-(2-tert-butyl-5-methyl-phenoxy)propoxy]piperidin-1-ium

Systemtic Name: 4-[3-(2-tert-butyl-5-methyl-phenoxy)propoxy]piperidin-1-ium Openeye Name: 4-[3-(2-tert-butyl-5-methyl-phenoxy)propoxy]piperidin-1-ium CAS Name: 4-[3-(2-tert-butyl-5-methylphenoxy)propoxy]piperidin-1-ium IUPAC Name: 4-[3-(2-tert-butyl-5-methylphenoxy)propoxy]piperidin-1-ium Traditional Name: 4-[3-(2-tert-butyl-5-methyl-phenoxy)propoxy]piperidin-1-ium Formula: C19H32NO2+ MolecularWeight: 306.46288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)(C)C)OCCCOC2CC[NH2+]CC2

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)(C)C)OCCCOC2CC[NH2+]CC2

InChI

InChI=1S/C19H31NO2/c1-15-6-7-17(19(2,3)4)18(14-15)22-13-5-12-21-16-8-10-20-11-9-16/h6-7,14,16,20H,5,8-13H2,1-4H3/p+1